SCHEMBL3001194

SCHEMBL3001194

C/C(=N\Nc1nc2ccccc2s1)c1ccc(-c2cccc(S(=O)(=O)NC(=O)CCc3ccccc3)c2)o1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.89
CSNK1D P48730 3/20 0.43
MEN1 O00255 7/20 0.42
KMT2A Q03164 7/20 0.42
RAB9A P51151 6/20 0.42
MAPT P10636 6/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
MAPK1 P28482 3/20 0.42
GAA P10253 3/20 0.42
POLB P06746 1/20 0.41
HSP90AA1 P07900 2/20 0.40
LMNA P02545 4/20 0.39
NPC1 O15118 2/20 0.39
HPGD P15428 2/20 0.39
HTT P42858 2/20 0.39
ALDH1A1 P00352 2/20 0.39
ALOX12 P18054 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3001197 1.00 BCL2L1 (0.89) BCL2L1CSNK1DMEN1KMT2ARAB9A
SCHEMBL3005525 0.95 BCL2L1 (0.94) BCL2L1CSNK1DMEN1KMT2ARAB9A
SCHEMBL3005522 0.95 BCL2L1 (0.94) BCL2L1CSNK1DMEN1KMT2ARAB9A
SCHEMBL13209139 0.88 BCL2L1 (0.75) BCL2L1MEN1KMT2ARAB9AMAPT
Trifluoroacetic Acid SCHEMBL3007062 0.85 BCL2L1 (0.70) BCL2L1MEN1KMT2ARAB9AMAPT
Trifluoroacetic Acid SCHEMBL3007067 0.85 BCL2L1 (0.70) BCL2L1MEN1KMT2ARAB9AMAPT
SCHEMBL3013124 0.84 BCL2L1 (0.68) BCL2L1CSNK1DMEN1KMT2ARAB9A
SCHEMBL3007327 0.84 BCL2L1 (0.68) BCL2L1MEN1KMT2ARAB9AMAPT
SCHEMBL3007321 0.84 BCL2L1 (0.68) BCL2L1MEN1KMT2ARAB9AMAPT
SCHEMBL3014524 0.83 BCL2L1 (0.68) BCL2L1MEN1KMT2ARAB9AMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100197711-A1 BENZOTHIAZOLE COMPOUNDS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2010-08-05 US disclosed
US-20100197711-A1 BENZOTHIAZOLE COMPOUNDS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2010-08-05 US disclosed
US-20100197711-A1 BENZOTHIAZOLE COMPOUNDS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2010-08-05 US disclosed
EP-2193127-A1 BENZOTHIAZOLE COMPOUNDS The Walter and Eliza Hall Institute of Medical Research (AU) 2010-06-09 EP disclosed
WO-2009039553-A1 BENZOTHIAZOLE COMPOUNDS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2009-04-02 WO disclosed
WO-2009039553-A1 BENZOTHIAZOLE COMPOUNDS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2009-04-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100197711-A1 BENZOTHIAZOLE COMPOUNDS BAD, BCL2, BAX BCL2L1 4/4885CSNK1D 3076/4885MEN1 3073/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.